4-bromanyl-6-fluoranyl-5-(4-methylpiperazin-4-ium-1-yl)-1,3-dihydrobenzimidazole-2-thione

Systemtic Name: 4-bromanyl-6-fluoranyl-5-(4-methylpiperazin-4-ium-1-yl)-1,3-dihydrobenzimidazole-2-thione Openeye Name: 4-bromo-6-fluoro-5-(4-methylpiperazin-4-ium-1-yl)-1,3-dihydrobenzimidazole-2-thione CAS Name: 4-bromo-6-fluoro-5-(4-methyl-1-piperazin-4-iumyl)-1,3-dihydrobenzimidazole-2-thione IUPAC Name: 4-bromo-6-fluoro-5-(4-methylpiperazin-4-ium-1-yl)-1,3-dihydrobenzimidazole-2-thione Traditional Name: 4-bromo-6-fluoro-5-(4-methylpiperazin-4-ium-1-yl)-1,3-dihydrobenzimidazole-2-thione Formula: C12H15BrFN4S+ MolecularWeight: 346.241703

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=C(C=C3C(=C2Br)NC(=S)N3)F

Isomeric SMILES

C[NH+]1CCN(CC1)C2=C(C=C3C(=C2Br)NC(=S)N3)F

InChI

InChI=1S/C12H14BrFN4S/c1-17-2-4-18(5-3-17)11-7(14)6-8-10(9(11)13)16-12(19)15-8/h6H,2-5H2,1H3,(H2,15,16,19)/p+1